SCHEMBL4997532

SCHEMBL4997532

FC(F)(F)c1cccc(-c2cncc(N3CCN(c4ccncc4)CC3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.49
PIM2 Q9P1W9 5/20 0.48
PIM1 P11309 1/20 0.48
PIM3 Q86V86 1/20 0.48
AR P10275 1/20 0.47
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
RAF1 P04049 2/20 0.44
BRAF P15056 1/20 0.44
EPHX2 P34913 1/20 0.44
PHGDH O43175 1/20 0.43
RAD52 P43351 1/20 0.43
KDM4E B2RXH2 2/20 0.43
MTOR P42345 1/20 0.42
SMG1 Q96Q15 1/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPK13 O15264 1/20 0.41
MAPK9 P45984 1/20 0.41
MAPK12 P53778 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4997106 0.89 PIM1 (0.47) CNR2PIM2PIM1PIM3RAF1
SCHEMBL4997537 0.84 CYP11B1 (0.46) PIM2PIM1PIM3NPC1RAB9A
SCHEMBL4995130 0.83 PHGDH (0.49) RAB9APHGDHRAD52KDM4EPOLB
SCHEMBL5003456 0.82 PIM2 (0.45) PIM2PIM1PIM3NPC1RAB9A
SCHEMBL4997813 0.82 PIK3CA (0.55) PIM2PIM1RAD52
SCHEMBL4987364 0.82 HRH2 (0.48) CNR2PIM2PIM1NPC1RAB9A
SCHEMBL4996922 0.82 PIM2 (0.47) PIM2PIM1NPC1RAB9ARAD52
SCHEMBL4997181 0.81 MAPT (0.47) PIM2PIM1NPC1RAB9ARAD52
SCHEMBL4994089 0.81 NPSR1 (0.47) PIM2PIM1PIM3PHGDHKDM4E
SCHEMBL5000680 0.81 PIM1 (0.51) PIM2PIM1PIM3NPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases PRNP, PSEN1, PPP5C CNR2 2760/4885PIM2 1679/4885PIM1 1047/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.